acompound

Showing entry for 2-Hydroxy-3-Methoxybenzaldehyde

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0034886
Compound Name	2-Hydroxy-3-Methoxybenzaldehyde
Structure
Formula	C8H8O3
InchiKey	JJVNINGBHGBWJH-UHFFFAOYSA-N
SMILES	COc1cccc(c1O)C=O
Inchi	InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3
IUPAC	2-hydroxy-3-methoxybenzaldehyde
Molecular Weight	152.05
Pubchem Id	8991
Chembl Id	CHEMBL13859

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT005127	Serine/threonine-protein kinase/endoribonuclease IRE1	reviewed	Kinase	ERN1	-	2370	-	-
reviewed	BXGT005127	Serine/threonine-protein kinase/endoribonuclease IRE1	reviewed	Kinase	ERN1	-	5750	-	-

CHEMBL

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
O75460	BXGT005127	Serine/threonine-protein kinase/endoribonuclease IRE1	reviewed	Kinase	ERN1	IC50	'='	5750	nM
O75460	BXGT005127	Serine/threonine-protein kinase/endoribonuclease IRE1	reviewed	Kinase	ERN1	IC50	'='	2370	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF04820	Panax ginseng	Panax ginseng	0

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}